Receptor
PDB id Resolution Class Description Source Keywords
3WRC 2.4 Å EC: 1.13.11.- CRYSTAL STRUCTURE OF THE ANAEROBIC DESB-PROTOCATECHUATE (PCA SPHINGOMONAS PAUCIMOBILIS OXIDOREDUCTASE EXTRADIOL DIOXYGENASE FE2+ BINDING DOMAIN-DIMER
Ref.: MOLECULAR MECHANISM OF STRICT SUBSTRATE SPECIFICITY EXTRADIOL DIOXYGENASE, DESB, DERIVED FROM SPHINGOBI SYK-6 PLOS ONE V. 9 92249 2014
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
DHB B:502;
Valid;
none;
submit data
154.12 C7 H6 O4 c1cc(...
FE2 A:501;
B:501;
Part of Protein;
Part of Protein;
none;
none;
submit data
55.845 Fe [Fe+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3WRB 2.1 Å EC: 1.13.11.- CRYSTAL STRUCTURE OF THE ANAEROBIC H124F DESB-GALLATE COMPLE SPHINGOMONAS PAUCIMOBILIS OXIDOREDUCTASE EXTRADIOL DIOXYGENASE FE2+ BINDING DOMAIN-DIMER
Ref.: MOLECULAR MECHANISM OF STRICT SUBSTRATE SPECIFICITY EXTRADIOL DIOXYGENASE, DESB, DERIVED FROM SPHINGOBI SYK-6 PLOS ONE V. 9 92249 2014
Members (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3WR3 - GDE C7 H6 O5 c1c(cc(c(c....
2 3WRB - GDE C7 H6 O5 c1c(cc(c(c....
3 3WR9 - GDE C7 H6 O5 c1c(cc(c(c....
4 3WR4 - GDE C7 H6 O5 c1c(cc(c(c....
5 3WPM - GDE C7 H6 O5 c1c(cc(c(c....
6 3WRC - DHB C7 H6 O4 c1cc(c(cc1....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3WR3 - GDE C7 H6 O5 c1c(cc(c(c....
2 3WRB - GDE C7 H6 O5 c1c(cc(c(c....
3 3WR9 - GDE C7 H6 O5 c1c(cc(c(c....
4 3WR4 - GDE C7 H6 O5 c1c(cc(c(c....
5 3WPM - GDE C7 H6 O5 c1c(cc(c(c....
6 3WRC - DHB C7 H6 O4 c1cc(c(cc1....
50% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 3WR3 - GDE C7 H6 O5 c1c(cc(c(c....
2 3WRB - GDE C7 H6 O5 c1c(cc(c(c....
3 3WR9 - GDE C7 H6 O5 c1c(cc(c(c....
4 3WR4 - GDE C7 H6 O5 c1c(cc(c(c....
5 3WPM - GDE C7 H6 O5 c1c(cc(c(c....
6 3WRC - DHB C7 H6 O4 c1cc(c(cc1....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: DHB; Similar ligands found: 10
No: Ligand ECFP6 Tc MDL keys Tc
1 DHB 1 1
2 4A3 0.514286 0.655172
3 FHB 0.514286 0.72
4 IHB 0.514286 0.72
5 CHB 0.514286 0.72
6 QSB 0.514286 0.72
7 CUQ 0.45 0.826087
8 3HB 0.428571 0.761905
9 GDE 0.424242 0.913043
10 GHM 0.416667 0.681818
Similar Ligands (3D)
Ligand no: 1; Ligand: DHB; Similar ligands found: 1521
No: Ligand Similarity coefficient
1 4NC 1.0000
2 P9P 1.0000
3 9TW 1.0000
4 93K 1.0000
5 XX2 1.0000
6 2HO 1.0000
7 MYJ 1.0000
8 3HM 1.0000
9 INO 1.0000
10 NNO 1.0000
11 NPO 1.0000
12 1CO 1.0000
13 JLZ 0.9940
14 DHK 0.9809
15 4CS 0.9793
16 GAB 0.9791
17 VNL 0.9786
18 PHB 0.9779
19 8WO 0.9778
20 X0V 0.9772
21 HBD 0.9768
22 F31 0.9764
23 PAB 0.9764
24 L99 0.9762
25 SKM 0.9760
26 IFP 0.9759
27 WCE 0.9752
28 ZXD 0.9750
29 3NT 0.9745
30 P72 0.9742
31 PBZ 0.9731
32 0HO 0.9730
33 1Y6 0.9729
34 OVV 0.9729
35 4XR 0.9728
36 KOJ 0.9726
37 0HN 0.9725
38 GYE 0.9723
39 4MA 0.9722
40 4FH 0.9717
41 3AB 0.9715
42 E7Z 0.9706
43 53C 0.9703
44 4SX 0.9703
45 LNR 0.9702
46 4AA 0.9695
47 EKZ 0.9693
48 NMJ 0.9689
49 AC6 0.9685
50 1F1 0.9682
51 CN0 0.9681
52 8GC 0.9676
53 ISN 0.9675
54 4ZA 0.9674
55 6NT 0.9674
56 826 0.9672
57 LDP 0.9669
58 5HN 0.9662
59 3NY 0.9661
60 3A9 0.9660
61 ES7 0.9660
62 5WV 0.9660
63 4P5 0.9656
64 SW7 0.9653
65 2HU 0.9652
66 3OC 0.9650
67 KKN 0.9647
68 2ZM 0.9645
69 Z82 0.9643
70 174 0.9641
71 BDP 0.9638
72 DHS 0.9630
73 BRT 0.9629
74 JAW 0.9627
75 ABI 0.9626
76 2A9 0.9624
77 4Z4 0.9624
78 LCN 0.9623
79 FGZ 0.9623
80 QSH 0.9619
81 3PF 0.9617
82 3ID 0.9615
83 3BZ 0.9613
84 BGC 0.9605
85 FA0 0.9604
86 4WL 0.9599
87 GZL 0.9596
88 5NI 0.9595
89 VXX 0.9594
90 5QY 0.9592
91 6NI 0.9588
92 G4D 0.9585
93 LT2 0.9584
94 HX3 0.9582
95 3DO 0.9576
96 JDN 0.9575
97 5OB 0.9575
98 7W4 0.9570
99 4XV 0.9570
100 DMD 0.9569
101 TWO 0.9567
102 M4T 0.9565
103 5XC 0.9562
104 PHU 0.9560
105 DBH 0.9559
106 JB8 0.9556
107 J9T 0.9556
108 ADA 0.9550
109 BE2 0.9550
110 M1A 0.9549
111 67N 0.9548
112 9TZ 0.9548
113 NOY 0.9544
114 Q88 0.9543
115 NOJ 0.9540
116 BZ3 0.9540
117 ASC 0.9540
118 BEZ 0.9540
119 ORO 0.9537
120 GLC 0.9536
121 BZ2 0.9536
122 R8V 0.9536
123 EA1 0.9534
124 CFI 0.9534
125 86J 0.9533
126 5CU 0.9533
127 ASO 0.9530
128 COU 0.9529
129 12Q 0.9527
130 1SQ 0.9525
131 HQT 0.9524
132 PZI 0.9523
133 DGJ 0.9522
134 G3E 0.9522
135 1LQ 0.9521
136 3HA 0.9521
137 AX7 0.9520
138 270 0.9520
139 N5J 0.9518
140 2AL 0.9518
141 KJH 0.9517
142 HIS 0.9517
143 J5I 0.9516
144 7W1 0.9516
145 JBH 0.9515
146 SE2 0.9514
147 DOB 0.9514
148 5QX 0.9514
149 5RO 0.9512
150 V55 0.9510
151 ET2 0.9510
152 GCU 0.9510
153 5SG 0.9509
154 BHA 0.9505
155 ABV 0.9505
156 NCA 0.9505
157 E5X 0.9505
158 G2F 0.9504
159 4M0 0.9504
160 H42 0.9504
161 EUG 0.9503
162 D48 0.9503
163 5IQ 0.9502
164 IFL 0.9501
165 LGC 0.9501
166 ES0 0.9500
167 JPZ 0.9499
168 GTQ 0.9499
169 HDH 0.9499
170 FA1 0.9497
171 SAL 0.9494
172 2MI 0.9493
173 069 0.9492
174 D1X 0.9492
175 DIN 0.9491
176 4XS 0.9489
177 ICO 0.9489
178 PBC 0.9489
179 HQJ 0.9488
180 GTR 0.9487
181 IF7 0.9486
182 03V 0.9485
183 TTL 0.9484
184 CWM 0.9483
185 ES1 0.9483
186 ES5 0.9482
187 OCH 0.9482
188 5RG 0.9482
189 3F0 0.9482
190 F0J 0.9479
191 2AQ 0.9479
192 M2K 0.9479
193 1NP 0.9478
194 1LM 0.9478
195 5NU 0.9477
196 RSO 0.9477
197 AZ9 0.9475
198 A7W 0.9474
199 4HM 0.9473
200 5RN 0.9473
201 3U4 0.9472
202 PNZ 0.9472
203 KUF 0.9471
204 4FS 0.9469
205 HBA 0.9468
206 HHA 0.9465
207 4YS 0.9465
208 ANN 0.9465
209 2HQ 0.9464
210 G3F 0.9464
211 ICB 0.9464
212 O72 0.9464
213 AHR 0.9463
214 54G 0.9461
215 VGL 0.9461
216 7MU 0.9460
217 FAN 0.9459
218 2K4 0.9458
219 HQD 0.9457
220 5Q0 0.9456
221 F60 0.9455
222 4M4 0.9454
223 5M0 0.9453
224 GCS 0.9452
225 ISZ 0.9452
226 BPN 0.9452
227 ES6 0.9451
228 BZX 0.9451
229 JB5 0.9450
230 4SV 0.9449
231 DNF 0.9449
232 DOR 0.9447
233 GLU 0.9446
234 JBK 0.9446
235 6RQ 0.9446
236 HA5 0.9445
237 15N 0.9445
238 6PC 0.9445
239 FE DB1 0.9444
240 FBB 0.9444
241 BEN 0.9444
242 TSU 0.9444
243 45L 0.9444
244 GAL 0.9442
245 2BG 0.9441
246 HQY 0.9441
247 0W8 0.9441
248 E1T 0.9440
249 OAA 0.9440
250 SAN 0.9439
251 AL0 0.9438
252 14O 0.9438
253 J9Q 0.9438
254 6FZ 0.9436
255 QWN 0.9435
256 SKA 0.9435
257 0JD 0.9434
258 JAE 0.9433
259 BHO 0.9432
260 0N7 0.9432
261 8S0 0.9431
262 5H1 0.9431
263 24W 0.9430
264 NIO 0.9429
265 AC0 0.9429
266 RAT 0.9428
267 UNU 0.9428
268 1P3 0.9427
269 3M0 0.9427
270 K2T 0.9427
271 6CS 0.9427
272 0P6 0.9423
273 717 0.9422
274 8CM 0.9421
275 BEA 0.9420
276 CXF 0.9419
277 1P7 0.9419
278 KTA 0.9418
279 TPA 0.9417
280 SHA 0.9416
281 BAM 0.9416
282 4FA 0.9416
283 TYL 0.9415
284 92K 0.9415
285 SVD 0.9414
286 97T 0.9414
287 CWS 0.9413
288 5MI 0.9410
289 XX3 0.9409
290 FBW 0.9409
291 MLT 0.9409
292 15L 0.9408
293 3IT 0.9408
294 3MB 0.9407
295 L5V 0.9407
296 MS9 0.9407
297 QUZ 0.9407
298 ISD 0.9406
299 CLW 0.9405
300 51R 0.9404
301 PAC 0.9403
302 6AI 0.9402
303 NBZ 0.9402
304 QIC 0.9400
305 NPY 0.9400
306 SYV 0.9400
307 5MB 0.9399
308 8WT 0.9398
309 ES2 0.9398
310 7WR 0.9398
311 0F9 0.9398
312 AW5 0.9397
313 4J8 0.9397
314 YCP 0.9397
315 N2Z 0.9396
316 1M2 0.9396
317 FBS 0.9396
318 TIU 0.9395
319 ESX 0.9394
320 QXW 0.9393
321 173 0.9392
322 52C 0.9392
323 FP1 0.9388
324 BE7 0.9388
325 UFV 0.9388
326 OVM 0.9387
327 36R 0.9387
328 MRW 0.9386
329 PZA 0.9385
330 42J 0.9385
331 JZ7 0.9383
332 ODO 0.9383
333 9FE 0.9383
334 NTN 0.9383
335 AMH 0.9383
336 F9Y 0.9383
337 URS 0.9382
338 9ZE 0.9381
339 EOL 0.9379
340 OXC 0.9379
341 1GN 0.9379
342 GJZ 0.9379
343 SOE 0.9379
344 SN4 0.9378
345 DYA 0.9378
346 9FL 0.9377
347 34D 0.9377
348 4VP 0.9377
349 XIY 0.9377
350 2D0 0.9376
351 NDH 0.9374
352 PIY 0.9373
353 BNS 0.9370
354 JKE 0.9369
355 7HQ 0.9368
356 3SK 0.9368
357 5MK 0.9366
358 XQ0 0.9366
359 LMR 0.9365
360 2FG 0.9365
361 FBM 0.9364
362 FA3 0.9363
363 OTR 0.9362
364 MQN 0.9362
365 KBG 0.9361
366 I3A 0.9361
367 SLS 0.9358
368 SS1 0.9357
369 SX1 0.9356
370 4NM 0.9353
371 11S 0.9353
372 9CA 0.9352
373 2FY 0.9352
374 XXG 0.9349
375 ONR 0.9349
376 H7Y 0.9349
377 FCR 0.9349
378 SRT 0.9347
379 XCZ 0.9347
380 FOT 0.9347
381 N3W 0.9347
382 XM0 0.9347
383 4JQ 0.9346
384 7N0 0.9346
385 4JT 0.9344
386 S2G 0.9341
387 TH7 0.9341
388 PIM 0.9340
389 UGC 0.9340
390 40E 0.9340
391 DHR 0.9339
392 OW4 0.9338
393 5B1 0.9337
394 A29 0.9337
395 IJZ 0.9337
396 YRL 0.9336
397 8ZE 0.9335
398 AFR 0.9335
399 1IT 0.9335
400 5VM 0.9335
401 ADE 0.9333
402 MR1 0.9332
403 F9P 0.9332
404 JFJ 0.9331
405 IV2 0.9329
406 R9S 0.9329
407 12T 0.9328
408 Q6T 0.9328
409 IPB 0.9326
410 AAS 0.9326
411 92P 0.9326
412 UNC 0.9325
413 6TZ 0.9325
414 VOH 0.9324
415 2CK 0.9323
416 ALL 0.9322
417 MSR 0.9321
418 1P8 0.9320
419 82I 0.9320
420 FEH 0.9319
421 DHI 0.9316
422 6M9 0.9316
423 CTL 0.9316
424 ES9 0.9315
425 2HC 0.9314
426 HIO 0.9312
427 WOO 0.9311
428 NIZ 0.9310
429 QSC 0.9309
430 0TU 0.9309
431 268 0.9309
432 4XH 0.9308
433 FK1 0.9308
434 AEH 0.9308
435 SJ5 0.9307
436 PXL 0.9307
437 AEF 0.9306
438 K97 0.9306
439 OGA 0.9306
440 BSX 0.9305
441 42C 0.9305
442 YIO 0.9304
443 GVG 0.9304
444 FYU 0.9302
445 7NI 0.9302
446 HC4 0.9301
447 GUA 0.9299
448 FBA 0.9297
449 HY1 0.9296
450 7WG 0.9296
451 PRZ 0.9295
452 AMS 0.9295
453 3XX 0.9292
454 EVA 0.9291
455 23A 0.9289
456 ESI 0.9288
457 COI 0.9287
458 F05 0.9287
459 R20 0.9286
460 HH8 0.9286
461 C2Y 0.9285
462 LYL 0.9285
463 RNS 0.9284
464 5LA 0.9283
465 2LP 0.9282
466 0RW 0.9281
467 H4N 0.9281
468 HLR 0.9281
469 PEA 0.9281
470 X6X 0.9280
471 C2B 0.9279
472 AKH 0.9277
473 N8Y 0.9277
474 OK7 0.9277
475 HPA 0.9277
476 VNJ 0.9276
477 RIB 0.9274
478 GCB 0.9274
479 MCT 0.9270
480 HMH 0.9270
481 OVP 0.9268
482 DE5 0.9268
483 F4E 0.9268
484 10L 0.9268
485 HMU 0.9267
486 M58 0.9266
487 1WD 0.9265
488 IFM 0.9264
489 TH0 0.9264
490 CPZ 0.9264
491 I1E 0.9263
492 GLA 0.9263
493 4YO 0.9262
494 GXL 0.9261
495 EXD 0.9261
496 OXZ 0.9261
497 K5W 0.9261
498 4JM 0.9260
499 3Z8 0.9260
500 TGX 0.9259
501 K34 0.9259
502 TZF 0.9258
503 M45 0.9258
504 DQA 0.9257
505 H8N 0.9257
506 URF 0.9256
507 C1M 0.9256
508 ASP 0.9256
509 SNU 0.9255
510 M1Q 0.9255
511 AKG 0.9254
512 BCU 0.9253
513 RM1 0.9252
514 2LY 0.9252
515 948 0.9251
516 149 0.9251
517 261 0.9250
518 259 0.9248
519 39O 0.9248
520 QY9 0.9247
521 9EW 0.9246
522 SVN 0.9245
523 3AL 0.9245
524 URC 0.9243
525 SWD 0.9242
526 2EC 0.9242
527 KJU 0.9242
528 M1H 0.9241
529 4JL 0.9241
530 NCT 0.9238
531 8XL 0.9238
532 4HO 0.9238
533 GIV 0.9237
534 JND 0.9237
535 KT7 0.9237
536 JTH 0.9237
537 FB2 0.9237
538 2H5 0.9236
539 VGD 0.9235
540 WBU 0.9234
541 N2I 0.9233
542 GLF 0.9232
543 H4E 0.9232
544 7WV 0.9230
545 OMD 0.9230
546 HSO 0.9230
547 6M4 0.9228
548 GIF 0.9227
549 36E 0.9227
550 4ME 0.9226
551 0W1 0.9225
552 4ZE 0.9225
553 MAJ 0.9224
554 7HP 0.9224
555 AMC 0.9223
556 MZG 0.9222
557 JZ2 0.9222
558 GLN 0.9222
559 9DA 0.9222
560 KBB 0.9222
561 PA1 0.9221
562 5GU 0.9221
563 GAF 0.9221
564 XYL 0.9220
565 RB5 0.9220
566 XBZ 0.9219
567 CTS 0.9218
568 4AV 0.9217
569 HLZ 0.9217
570 2AC 0.9216
571 QBK 0.9216
572 1PT 0.9216
573 4NG 0.9215
574 3QM 0.9215
575 PQK 0.9212
576 FQI 0.9212
577 2RH 0.9211
578 ONL 0.9210
579 TTY 0.9210
580 42A 0.9209
581 4JJ 0.9209
582 SAF 0.9207
583 FBV 0.9207
584 5JC 0.9206
585 9HX 0.9206
586 15E 0.9206
587 A13 0.9205
588 6MP 0.9203
589 XYD 0.9202
590 0FK 0.9202
591 3FH 0.9202
592 8HC 0.9202
593 DHY 0.9201
594 MWM 0.9201
595 LZ1 0.9200
596 LZM 0.9199
597 DBJ 0.9199
598 MWJ 0.9199
599 DBX 0.9199
600 Z5P 0.9197
601 AGK 0.9197
602 TDR 0.9197
603 8NY 0.9197
604 APZ 0.9197
605 M0W 0.9197
606 7VS 0.9196
607 75K 0.9196
608 ZZT 0.9195
609 2F6 0.9194
610 QOS 0.9194
611 A1U 0.9194
612 B62 0.9194
613 CH9 0.9194
614 HJP 0.9194
615 2MP 0.9193
616 J9N 0.9193
617 3MG 0.9191
618 IND 0.9191
619 RNT 0.9190
620 34A 0.9190
621 Q24 0.9189
622 ASN 0.9188
623 M6N 0.9188
624 MPV 0.9187
625 GF4 0.9186
626 AX3 0.9186
627 1MC 0.9186
628 IT2 0.9185
629 DGL 0.9185
630 2IT 0.9185
631 QWW 0.9185
632 4CL 0.9184
633 DEN 0.9184
634 GUN 0.9183
635 XHP 0.9182
636 J9W 0.9182
637 0R1 0.9182
638 BR9 0.9180
639 MXN 0.9180
640 24B 0.9180
641 PD2 0.9179
642 PBA 0.9177
643 3HP 0.9177
644 27Y 0.9177
645 7B4 0.9177
646 QMP 0.9176
647 RUY 0.9176
648 7WA 0.9176
649 ZYR 0.9176
650 3SL 0.9176
651 UNJ 0.9175
652 MBG 0.9174
653 AZ8 0.9174
654 AJV 0.9173
655 428 0.9173
656 BTY 0.9173
657 FDB 0.9172
658 NK 0.9172
659 B85 0.9172
660 JG8 0.9172
661 AJY 0.9171
662 GLT 0.9171
663 36Y 0.9171
664 EYK 0.9170
665 5MH 0.9170
666 M0Q 0.9168
667 JBE 0.9167
668 8OZ 0.9167
669 M3H 0.9165
670 KJY 0.9164
671 EDR 0.9164
672 6LW 0.9161
673 2FQ 0.9161
674 X05 0.9160
675 JA8 0.9160
676 2YU 0.9160
677 FB1 0.9159
678 NSP 0.9158
679 MPI 0.9158
680 PYF 0.9156
681 HL5 0.9155
682 FDK 0.9155
683 44W 0.9155
684 DQU 0.9155
685 2O6 0.9155
686 264 0.9155
687 RHU 0.9155
688 463 0.9154
689 XAZ 0.9153
690 RBL 0.9153
691 HBX 0.9153
692 BZF 0.9153
693 C2A 0.9153
694 8H8 0.9153
695 IAC 0.9153
696 44V 0.9152
697 GVH 0.9152
698 AJ2 0.9152
699 4HC 0.9151
700 AZA 0.9151
701 FDR 0.9150
702 P92 0.9150
703 PMB 0.9150
704 OTW 0.9149
705 PYD 0.9148
706 ICP 0.9148
707 1A7 0.9148
708 GJP 0.9148
709 54D 0.9148
710 SS2 0.9148
711 ADZ 0.9147
712 SWA 0.9146
713 4P0 0.9145
714 KDV 0.9145
715 5XB 0.9144
716 TM7 0.9144
717 GRE 0.9143
718 FH2 0.9142
719 94W 0.9142
720 XYP 0.9142
721 TOF 0.9141
722 PDC 0.9140
723 BTE 0.9139
724 BDF 0.9138
725 PJW 0.9138
726 BZI 0.9138
727 258 0.9136
728 C2U 0.9135
729 JZ3 0.9135
730 1DW 0.9135
731 AHB 0.9134
732 ZB1 0.9133
733 PE0 0.9133
734 INE 0.9133
735 QX2 0.9133
736 43M 0.9132
737 FBU 0.9131
738 M1E 0.9131
739 6AP 0.9131
740 HT4 0.9129
741 M4E 0.9129
742 SYA 0.9128
743 2XX 0.9128
744 6ME 0.9128
745 R8S 0.9128
746 NYL 0.9128
747 PHE 0.9128
748 0FN 0.9127
749 ALE 0.9127
750 XDE 0.9127
751 DS0 0.9127
752 4BL 0.9127
753 PEY 0.9126
754 MEW 0.9126
755 1HN 0.9125
756 4MU 0.9124
757 B57 0.9124
758 M5K 0.9123
759 BNF 0.9123
760 LXC 0.9123
761 P3K 0.9122
762 4RU 0.9122
763 1DJ 0.9121
764 DMJ 0.9121
765 TSS 0.9121
766 IP0 0.9121
767 KTW 0.9121
768 G6D 0.9121
769 CXH 0.9120
770 LEU 0.9120
771 5UC 0.9119
772 GXY 0.9119
773 3PG 0.9119
774 495 0.9119
775 FPI 0.9119
776 HG3 0.9118
777 7ME 0.9117
778 DGN 0.9116
779 HHH 0.9115
780 KYA 0.9115
781 HPS 0.9114
782 BP1 0.9113
783 MUA 0.9113
784 A5E 0.9112
785 AQO 0.9112
786 8NX 0.9112
787 449 0.9111
788 4JC 0.9111
789 0R0 0.9109
790 I3E 0.9108
791 MNN 0.9108
792 MT0 0.9108
793 8TX 0.9107
794 9RW 0.9107
795 NID 0.9107
796 3C4 0.9106
797 1XA 0.9105
798 XAN 0.9104
799 EHM 0.9103
800 MO8 0.9103
801 DFB 0.9103
802 EV0 0.9103
803 0BP 0.9102
804 MWP 0.9102
805 293 0.9102
806 4BY 0.9102
807 5JQ 0.9101
808 ORN 0.9101
809 3Z7 0.9101
810 L3Q 0.9100
811 9DG 0.9100
812 H62 0.9099
813 TCA 0.9099
814 DIU 0.9097
815 PO6 0.9093
816 CWJ 0.9093
817 URQ 0.9093
818 NLE 0.9092
819 AH8 0.9092
820 PM6 0.9092
821 NAG 0.9091
822 4NB 0.9091
823 NBE 0.9091
824 2PG 0.9090
825 3ZB 0.9090
826 FK8 0.9090
827 0FO 0.9090
828 8G0 0.9089
829 F12 0.9089
830 4PN 0.9088
831 G5V 0.9088
832 SOR 0.9088
833 SHG 0.9086
834 AZG 0.9086
835 TEP 0.9086
836 6KT 0.9085
837 PZM 0.9085
838 DEW 0.9085
839 SMN 0.9085
840 HDL 0.9085
841 QX4 0.9085
842 XUL 0.9084
843 JYD 0.9084
844 9MG 0.9083
845 3DM 0.9082
846 6M1 0.9082
847 ALA ALA 0.9080
848 EGR 0.9080
849 RMN 0.9080
850 XRG 0.9080
851 O2A 0.9078
852 MNM 0.9077
853 XQG 0.9077
854 B55 0.9077
855 DHQ 0.9077
856 XSP 0.9076
857 6F0 0.9076
858 S76 0.9076
859 4BZ 0.9075
860 QPR 0.9073
861 GAG 0.9073
862 AMQ 0.9072
863 1KP 0.9072
864 URO 0.9072
865 EMZ 0.9072
866 Y8I 0.9071
867 M4S 0.9071
868 6GU 0.9071
869 14J 0.9071
870 LQ2 0.9070
871 9R5 0.9070
872 TEO 0.9070
873 2AK 0.9069
874 282 0.9069
875 ABN 0.9069
876 PY7 0.9065
877 PEP 0.9065
878 2HG 0.9065
879 37T 0.9064
880 L14 0.9063
881 FPY 0.9063
882 0V5 0.9062
883 PEQ 0.9062
884 IDM 0.9062
885 2ZV 0.9062
886 2FT 0.9061
887 A2F 0.9061
888 RXA 0.9061
889 YPN 0.9060
890 60P 0.9060
891 AY4 0.9059
892 FUD 0.9059
893 S2P 0.9058
894 GV9 0.9058
895 DRL 0.9058
896 AEG 0.9058
897 MAN 0.9057
898 1XN 0.9057
899 XDK 0.9056
900 XXP 0.9055
901 SYN 0.9055
902 1SA 0.9055
903 5WY 0.9055
904 T9G 0.9055
905 MJ2 0.9053
906 LPK 0.9053
907 AOS 0.9051
908 ES4 0.9051
909 4ZC 0.9051
910 TLA 0.9051
911 IGA 0.9050
912 TZE 0.9049
913 HHI 0.9049
914 95Z 0.9048
915 HZQ 0.9047
916 NQ 0.9046
917 M1Z 0.9044
918 2GS 0.9043
919 2A7 0.9043
920 3R6 0.9043
921 2CQ 0.9043
922 MET 0.9042
923 GBD 0.9041
924 PRA 0.9041
925 MVN 0.9040
926 TLD 0.9040
927 F81 0.9040
928 5AC 0.9040
929 T6C 0.9039
930 8NB 0.9038
931 4V2 0.9037
932 25W 0.9035
933 BK9 0.9034
934 1AL 0.9034
935 BNL 0.9032
936 AZF 0.9032
937 TAG 0.9032
938 IWT 0.9031
939 GRO 0.9031
940 LRH 0.9031
941 5JL 0.9031
942 BPY 0.9031
943 7ZE 0.9030
944 GGL 0.9029
945 EVF 0.9029
946 YH7 0.9029
947 TT4 0.9027
948 DNC 0.9025
949 XBT 0.9025
950 PEL 0.9024
951 7MK 0.9024
952 0LH 0.9024
953 JZ4 0.9023
954 23J 0.9023
955 141 0.9022
956 6OT 0.9022
957 HSE 0.9021
958 263 0.9020
959 GOJ 0.9020
960 4JO 0.9019
961 IUR 0.9019
962 VK3 0.9018
963 OXQ 0.9018
964 UAN 0.9017
965 R2B 0.9016
966 MRZ 0.9016
967 MT5 0.9016
968 P7Y 0.9016
969 ZZ3 0.9015
970 32X 0.9015
971 DEE 0.9014
972 SD4 0.9014
973 0CT 0.9014
974 SEP 0.9011
975 9PY 0.9011
976 OHP 0.9010
977 PRY 0.9009
978 E7S 0.9009
979 150 0.9009
980 8U3 0.9008
981 PKU 0.9008
982 290 0.9007
983 0MK 0.9006
984 PCA 0.9004
985 GWM 0.9004
986 DIE 0.9002
987 PYQ 0.9001
988 R9Y 0.8999
989 GZ3 0.8998
990 4TU 0.8998
991 FUL 0.8998
992 JF6 0.8998
993 AN3 0.8998
994 X0W 0.8996
995 RBJ 0.8996
996 IDH 0.8994
997 DFU 0.8994
998 9KT 0.8994
999 4JP 0.8993
1000 NF3 0.8993
1001 7VP 0.8991
1002 Z6J 0.8991
1003 69O 0.8991
1004 SRO 0.8991
1005 DX4 0.8990
1006 TAR 0.8990
1007 HF2 0.8989
1008 7MH 0.8989
1009 5WU 0.8988
1010 HXX 0.8988
1011 8IG 0.8987
1012 SNO 0.8987
1013 Q02 0.8986
1014 KBZ 0.8985
1015 9X7 0.8984
1016 JZ9 0.8983
1017 TSR 0.8983
1018 FUC 0.8982
1019 NGO 0.8981
1020 8K2 0.8981
1021 1WG 0.8980
1022 B53 0.8979
1023 LI6 0.8979
1024 M6W 0.8978
1025 QBM 0.8978
1026 1DV 0.8978
1027 LDU 0.8977
1028 CFP 0.8977
1029 HH5 0.8977
1030 OW7 0.8976
1031 B2J 0.8976
1032 H76 0.8975
1033 61M 0.8974
1034 HQ9 0.8974
1035 1DU 0.8974
1036 CFF 0.8973
1037 2TQ 0.8973
1038 JRB 0.8973
1039 R2P 0.8972
1040 DA4 0.8971
1041 209 0.8971
1042 6R8 0.8971
1043 7MX 0.8970
1044 WOT 0.8970
1045 286 0.8968
1046 DAS 0.8967
1047 8W9 0.8966
1048 YTX 0.8966
1049 35C 0.8966
1050 9ON 0.8965
1051 FCA 0.8964
1052 1MR 0.8962
1053 HFA 0.8962
1054 AS3 0.8961
1055 3BU 0.8959
1056 J6W 0.8959
1057 505 0.8958
1058 SPV 0.8957
1059 4VY 0.8957
1060 C21 0.8957
1061 MZB 0.8956
1062 1XM 0.8956
1063 ZZZ 0.8955
1064 EN1 0.8955
1065 2DR 0.8955
1066 BMA 0.8954
1067 OKG 0.8953
1068 PRO 0.8953
1069 RIP 0.8953
1070 AHN 0.8953
1071 H33 0.8953
1072 MPK 0.8953
1073 ICF 0.8952
1074 CXP 0.8951
1075 BQ2 0.8950
1076 NVU 0.8950
1077 HX4 0.8949
1078 ZBT 0.8949
1079 L22 0.8947
1080 7VJ 0.8947
1081 6QF 0.8947
1082 MZW 0.8946
1083 BP9 0.8946
1084 7D2 0.8945
1085 3YP 0.8944
1086 PH2 0.8943
1087 BZJ 0.8943
1088 13P 0.8943
1089 2MN 0.8942
1090 28N 0.8940
1091 JIF 0.8940
1092 N1E 0.8939
1093 BNT 0.8939
1094 3HG 0.8938
1095 K7M 0.8938
1096 R67 0.8938
1097 SR1 0.8937
1098 S24 0.8937
1099 FRU 0.8934
1100 27B 0.8934
1101 A65 0.8933
1102 B40 0.8933
1103 9CL 0.8932
1104 344 0.8931
1105 2CZ 0.8930
1106 PPY 0.8929
1107 F4Z 0.8929
1108 UEG 0.8929
1109 45C 0.8929
1110 BOA 0.8929
1111 XYS 0.8929
1112 R8A 0.8929
1113 LYS 0.8928
1114 GCO 0.8928
1115 SHI 0.8927
1116 1LN 0.8927
1117 PFB 0.8927
1118 CRN 0.8926
1119 IOM 0.8926
1120 F69 0.8926
1121 GLO 0.8923
1122 FBJ 0.8923
1123 TC7 0.8923
1124 JFD 0.8923
1125 0OC 0.8922
1126 JZ1 0.8922
1127 JBQ 0.8922
1128 SMV 0.8922
1129 ARP 0.8920
1130 329 0.8919
1131 JZ5 0.8919
1132 JXN 0.8917
1133 FOA 0.8917
1134 TYE 0.8915
1135 FBT 0.8915
1136 1L5 0.8915
1137 ESP 0.8914
1138 PXM 0.8913
1139 2BX 0.8913
1140 LKA 0.8913
1141 II6 0.8912
1142 0CU 0.8912
1143 APS 0.8911
1144 2ZQ 0.8911
1145 PRF 0.8910
1146 A9P 0.8909
1147 B24 0.8907
1148 F4K 0.8907
1149 AOT 0.8905
1150 3WA 0.8905
1151 KTJ 0.8904
1152 F5B 0.8903
1153 PHH 0.8900
1154 GO2 0.8900
1155 2MH 0.8900
1156 30G 0.8899
1157 RNO 0.8899
1158 CLZ 0.8898
1159 3QV 0.8896
1160 ABE 0.8895
1161 4HP 0.8895
1162 RSF 0.8892
1163 A09 0.8890
1164 HHR 0.8889
1165 2AS 0.8888
1166 UY7 0.8888
1167 EQT 0.8887
1168 SKF 0.8887
1169 KGK 0.8886
1170 N7I 0.8886
1171 E4P 0.8885
1172 ARW 0.8885
1173 FF2 0.8885
1174 271 0.8885
1175 FHC 0.8883
1176 5NE 0.8881
1177 BCP 0.8880
1178 SME 0.8879
1179 39A 0.8878
1180 LR5 0.8877
1181 RPQ 0.8876
1182 N91 0.8875
1183 GZ2 0.8875
1184 A7N 0.8873
1185 SF9 0.8873
1186 S7J 0.8872
1187 APG 0.8872
1188 HA7 0.8871
1189 RAM 0.8870
1190 265 0.8869
1191 ZWZ 0.8868
1192 KMT 0.8868
1193 HCI 0.8868
1194 CEE 0.8866
1195 4JU 0.8865
1196 TP5 0.8864
1197 KP6 0.8864
1198 QUS 0.8863
1199 FBF 0.8861
1200 TBP 0.8860
1201 F1A 0.8860
1202 8GL 0.8859
1203 LAO 0.8859
1204 3VX 0.8859
1205 PQ0 0.8858
1206 IOS 0.8858
1207 2K8 0.8856
1208 S0E 0.8856
1209 GLY PRO 0.8856
1210 1U6 0.8856
1211 9YL 0.8855
1212 AA 0.8854
1213 IPZ 0.8854
1214 5VL 0.8854
1215 HCS 0.8852
1216 PH3 0.8852
1217 2PC 0.8852
1218 GTL 0.8851
1219 MSN 0.8851
1220 KYD 0.8851
1221 1QP 0.8850
1222 X09 0.8850
1223 1WC 0.8850
1224 BML 0.8850
1225 ANF 0.8849
1226 6VD 0.8849
1227 2KA 0.8848
1228 HNK 0.8848
1229 HNL 0.8848
1230 HHS 0.8848
1231 PMF 0.8848
1232 LFR 0.8847
1233 GBN 0.8846
1234 G3P 0.8846
1235 G3H 0.8846
1236 APY 0.8846
1237 XIZ 0.8846
1238 PYJ 0.8846
1239 SXS 0.8845
1240 SC2 0.8845
1241 0VT 0.8843
1242 OHG 0.8843
1243 E35 0.8842
1244 TZL 0.8842
1245 HSM 0.8842
1246 MAE 0.8842
1247 TZC 0.8842
1248 PFL 0.8841
1249 KMH 0.8840
1250 46P 0.8838
1251 ARB 0.8838
1252 B60 0.8836
1253 SDD 0.8835
1254 X0U 0.8835
1255 1X7 0.8835
1256 ANC 0.8835
1257 GCW 0.8834
1258 2QC 0.8833
1259 DX3 0.8832
1260 LSA 0.8832
1261 C9E 0.8831
1262 BZE 0.8831
1263 ROI 0.8830
1264 FA6 0.8830
1265 GIO 0.8828
1266 SYG 0.8827
1267 ILE 0.8825
1268 JBN 0.8825
1269 GLY GLY 0.8824
1270 3RK 0.8824
1271 HYP 0.8824
1272 4LW 0.8823
1273 4A5 0.8822
1274 51F 0.8822
1275 PYC 0.8821
1276 8XQ 0.8820
1277 UFO 0.8820
1278 1Z6 0.8819
1279 H6B 0.8818
1280 TZM 0.8817
1281 XXR 0.8816
1282 AIN 0.8816
1283 HNQ 0.8816
1284 2CL 0.8816
1285 HY3 0.8815
1286 CFA 0.8814
1287 AMG 0.8813
1288 SIN 0.8813
1289 MAQ 0.8812
1290 JF2 0.8812
1291 L7T 0.8809
1292 4KL 0.8809
1293 KFH 0.8809
1294 BSP 0.8809
1295 B5D 0.8808
1296 152 0.8808
1297 FCB 0.8807
1298 MB1 0.8807
1299 Q71 0.8806
1300 MFB 0.8803
1301 RD4 0.8803
1302 9KH 0.8803
1303 FUM 0.8803
1304 I4B 0.8801
1305 XQI 0.8800
1306 SNE 0.8797
1307 FUF 0.8794
1308 JF1 0.8792
1309 284 0.8792
1310 GNM 0.8791
1311 9RH 0.8790
1312 M6Z 0.8790
1313 5NS 0.8790
1314 SG2 0.8789
1315 4CH 0.8788
1316 D07 0.8785
1317 K17 0.8785
1318 K3Q 0.8784
1319 GZQ 0.8783
1320 535 0.8783
1321 TBS 0.8782
1322 G12 0.8782
1323 URP 0.8781
1324 MQB 0.8780
1325 HQE 0.8780
1326 X48 0.8779
1327 NDM 0.8777
1328 091 0.8776
1329 12M 0.8776
1330 DNA 0.8775
1331 0TR 0.8773
1332 RJY 0.8772
1333 PLQ 0.8771
1334 J1Z 0.8771
1335 FHN 0.8767
1336 PCR 0.8766
1337 DA1 0.8766
1338 FPN 0.8765
1339 BP7 0.8763
1340 6XI 0.8763
1341 HKD 0.8762
1342 NK2 0.8762
1343 RCO 0.8762
1344 JXZ 0.8760
1345 GOO 0.8760
1346 K6X 0.8757
1347 HX2 0.8757
1348 H5B 0.8756
1349 LG4 0.8756
1350 CRS 0.8756
1351 M2H 0.8755
1352 4HS 0.8754
1353 OA3 0.8753
1354 RM4 0.8753
1355 NDG 0.8753
1356 NTZ 0.8753
1357 THA 0.8752
1358 PXY 0.8752
1359 GCV 0.8750
1360 EXO 0.8749
1361 A7H 0.8749
1362 LZ2 0.8748
1363 PGH 0.8747
1364 G1O 0.8746
1365 CIT 0.8743
1366 QBS 0.8742
1367 0XT 0.8737
1368 363 0.8736
1369 KIB 0.8736
1370 KIA 0.8736
1371 SQ7 0.8735
1372 I6G 0.8733
1373 V1T 0.8731
1374 HGQ 0.8730
1375 6DP 0.8729
1376 68A 0.8727
1377 B3R 0.8727
1378 GP9 0.8726
1379 64K 0.8726
1380 CIG 0.8726
1381 5WX 0.8726
1382 92G 0.8725
1383 DC5 0.8725
1384 MAK 0.8723
1385 25R 0.8720
1386 8GK 0.8720
1387 W81 0.8720
1388 DRG 0.8719
1389 3R4 0.8719
1390 P9E 0.8718
1391 IOL 0.8718
1392 MAH 0.8717
1393 XQK 0.8716
1394 2D3 0.8716
1395 CK2 0.8715
1396 M3T 0.8714
1397 20J 0.8714
1398 7B3 0.8713
1399 HEW 0.8711
1400 680 0.8711
1401 PLU 0.8709
1402 A9O 0.8709
1403 AES 0.8708
1404 4H2 0.8705
1405 HLD 0.8705
1406 3J8 0.8705
1407 4JN 0.8705
1408 4NZ 0.8702
1409 JUG 0.8700
1410 273 0.8700
1411 1BN 0.8700
1412 7CZ 0.8698
1413 57O 0.8698
1414 PRS 0.8696
1415 4I8 0.8696
1416 0GZ 0.8696
1417 OTD 0.8696
1418 3CH 0.8695
1419 JAB 0.8695
1420 ZME 0.8693
1421 BVF 0.8693
1422 MVL 0.8692
1423 URA 0.8691
1424 3V4 0.8689
1425 L13 0.8689
1426 9AP 0.8688
1427 49O 0.8686
1428 EUE 0.8684
1429 KW8 0.8683
1430 LG5 0.8683
1431 K32 0.8682
1432 DHC 0.8681
1433 MHK 0.8681
1434 GDL 0.8680
1435 GLL 0.8680
1436 GOG 0.8680
1437 JU2 0.8680
1438 BBK 0.8679
1439 5CL 0.8676
1440 ADK 0.8674
1441 DTL 0.8674
1442 P4B 0.8672
1443 LDR 0.8671
1444 RUU 0.8667
1445 SLC 0.8666
1446 F2W 0.8665
1447 PEZ 0.8665
1448 TYR 0.8665
1449 PG3 0.8665
1450 DPT 0.8664
1451 86L 0.8661
1452 INS 0.8660
1453 PBE 0.8660
1454 BPU 0.8658
1455 5TY 0.8658
1456 HHQ 0.8657
1457 DPZ 0.8656
1458 P80 0.8654
1459 JP2 0.8652
1460 FLC 0.8652
1461 LG3 0.8652
1462 1VK 0.8650
1463 TFU 0.8649
1464 KDF 0.8647
1465 MMA 0.8644
1466 X8D 0.8642
1467 Z13 0.8641
1468 275 0.8641
1469 SYR 0.8640
1470 KIV 0.8640
1471 26D 0.8639
1472 OQC 0.8636
1473 692 0.8634
1474 PPT 0.8633
1475 JXW 0.8632
1476 ISE 0.8627
1477 DZX 0.8626
1478 IZC 0.8624
1479 E3D 0.8623
1480 23W 0.8623
1481 9BF 0.8621
1482 3MA 0.8620
1483 1DQ 0.8619
1484 6X9 0.8618
1485 7I2 0.8618
1486 N0Z 0.8618
1487 TMG 0.8617
1488 K22 0.8616
1489 MOK 0.8615
1490 CYT 0.8615
1491 CIY 0.8612
1492 NLA 0.8612
1493 ICT 0.8608
1494 JR2 0.8608
1495 MXD 0.8607
1496 6BL 0.8606
1497 47J 0.8605
1498 8GF 0.8603
1499 54X 0.8603
1500 KMY 0.8600
1501 3R9 0.8597
1502 KJ5 0.8596
1503 Q7A 0.8595
1504 M5H 0.8594
1505 3AE 0.8593
1506 CKA 0.8592
1507 NGA 0.8587
1508 XCG 0.8586
1509 PYG 0.8580
1510 SIF 0.8570
1511 PGA 0.8567
1512 ENO 0.8563
1513 T2C 0.8563
1514 P84 0.8560
1515 NCD 0.8560
1516 GVY 0.8555
1517 NBG 0.8550
1518 6MH 0.8528
1519 DQN 0.8526
1520 TM4 0.8522
1521 36M 0.8519
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3WRB; Ligand: GDE; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 3wrb.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3WRB; Ligand: GDE; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 3wrb.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
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